(1-oxidanylidene-1-tetradecoxy-hexan-2-yl)azanium; N-(1-oxidanylidene-1-tetradecoxy-hexan-2-yl)carbamate

Systemtic Name: (1-oxidanylidene-1-tetradecoxy-hexan-2-yl)azanium; N-(1-oxidanylidene-1-tetradecoxy-hexan-2-yl)carbamate Openeye Name: 1-tetradecoxycarbonylpentylammonium; N-(1-tetradecoxycarbonylpentyl)carbamate CAS Name: (1-oxo-1-tetradecoxyhexan-2-yl)ammonium; N-(1-oxo-1-tetradecoxyhexan-2-yl)carbamate IUPAC Name: (1-oxo-1-tetradecoxyhexan-2-yl)azanium; N-(1-oxo-1-tetradecoxyhexan-2-yl)carbamate Traditional Name: 1-myristyloxycarbonylpentylammonium; N-(1-myristyloxycarbonylpentyl)carbamate Formula: C41H82N2O6 MolecularWeight: 699.09958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(=O)C(CCCC)[NH3+].CCCCCCCCCCCCCCOC(=O)C(CCCC)NC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCOC(=O)C(CCCC)[NH3+].CCCCCCCCCCCCCCOC(=O)C(CCCC)NC(=O)[O-]

InChI

InChI=1S/C21H41NO4.C20H41NO2/c1-3-5-7-8-9-10-11-12-13-14-15-16-18-26-20(23)19(17-6-4-2)22-21(24)25;1-3-5-7-8-9-10-11-12-13-14-15-16-18-23-20(22)19(21)17-6-4-2/h19,22H,3-18H2,1-2H3,(H,24,25);19H,3-18,21H2,1-2H3